7407-0568 Screening compound: 3-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-3-hydroxy-1-(propan-2-yl)-2,3-dihydro-1H-indol-2-one

7407-0568 Screening compound: 3-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-3-hydroxy-1-(propan-2-yl)-2,3-dihydro-1H-indol-2-one
7407-0568 Screening compound: 3-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-3-hydroxy-1-(propan-2-yl)-2,3-dihydro-1H-indol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 7407-0568
3-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-3-hydroxy-1-(propan-2-yl)-2,3-dihydro-1H-indol-2-one

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

7407-0568

Molecular Formula

C21H23NO5 (C21 H23 NO5)

Compound Name

3-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-3-hydroxy-1-(propan-2-yl)-2,3-dihydro-1H-indol-2-one

IUPAC name

3-[2-(34-dimethoxyphenyl)-2-oxoethyl]-3-hydroxy-1-(propan-2-yl)-23-dihydro-1H-indol-2-one

SMILES

CC(C)N(C(C1(CC(c(cc2)cc(OC)c2OC)=O)O)=O)c2c1cccc2

InChI

InChI=1S/C21H23NO5/c1-13(2)22-16-8-6-5-7-15(16)21(25,20(22)24)12-17(23)14-9-10-18(26-3)19(11-14)27-4/h5-11,13,25H,12H2,1-4H3/t21-/m0/s1

InChI Key

PPWYHNYSZHBHDZ-NRFANRHFSA-N

MDL Number (MFCD)

MFCD03836553

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

369.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.388

Distribution Coefficient, logD

2.388

Water Solubility, LogSw

-2.81

Polar Surface Area

59.296

Acid Dissociation Constant (pKa)

14.32

Base Dissociation Constant (pKb)

-1.16

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

7407-0568 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Cardiovascular Library (22201 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular

References: we are preparing a list of scientific research reports with 7407-0568 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7407-0568?
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What is the minimum amount of 7407-0568 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7407-0568
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7407-0568
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 7407-0568 available by request